| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 30 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.22 | 9.66 | -55.98 | 0 | 6 | -1 | 83 | 439.9 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.66 | 9.11 | -9.35 | 1 | 6 | 0 | 80 | 440.908 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.63 | -0.31 | -10.98 | 0 | 6 | 0 | 76 | 440.908 | 5 | ↓ |
